N-[2-(azepan-1-yl)ethyl]-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-1767 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C24 H36 N4 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCCC(C1)C(NCCN1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8812 |
| logD: | 0.0985 |
| logSw: | -2.6106 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.06 |
| InChI Key: | HTJIQMSHZMBSGQ-UHFFFAOYSA-N |